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4,6-Dibromo-1,3,5-triazin-2-amine

HCID 20613
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Basic information

CAS
4514-62-9
Standard SMILES
Nc1nc(Br)nc(Br)n1
InChIKey
OFVRHKVNUKMGEE-UHFFFAOYSA-N
Molecular formula
C3H2Br2N4
Average molar mass
253.88 g/mol
Monoisotopic mass
251.86462

Names & identifiers

Preferred name
4,6-Dibromo-1,3,5-triazin-2-amine
IUPAC
4,6-dibromo-1,3,5-triazin-2-amine

Names & synonyms

4,6-dibromo-1,3,5-triazin-2-amine4514-62-9SCHEMBL10937578DTXSID101298837CS-38785

Database identifiers

CAS
4514-62-9
PubChem CID
20613
DTXSID
DTXSID101298837
Nikkaji
J1.554.113J

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
64.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
9
Formal charge
0
Complexity
89.8

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Compound notes

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